Geometry & MOs

Info

ID:	4471
PubChem CID:	11457
Reduced:	BrNO2H4C6 (1)
Stoich.:	ABC2D4E6 (1)
Weight, g/mol:	200.94254
ΔH_f, kcal/mol:	22.39
Dipole, Da:	4.55
IP(EA), eV:	-10.37(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-3-nitrobenzene

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Br)[N+](=O)[O-]

DOS

IR

Vibrations